1-bromanyl-4-oxidanyl-N-(pyridin-2-ylmethyl)-[1]benzothiolo[3,2-c]pyridine-3-carboxamide

Systemtic Name: 1-bromanyl-4-oxidanyl-N-(pyridin-2-ylmethyl)-[1]benzothiolo[3,2-c]pyridine-3-carboxamide Openeye Name: 1-bromo-4-hydroxy-N-(2-pyridylmethyl)benzothiopheno[3,2-c]pyridine-3-carboxamide CAS Name: 1-bromo-4-hydroxy-N-(2-pyridinylmethyl)-[1]benzothiolo[3,2-c]pyridine-3-carboxamide IUPAC Name: 1-bromo-4-hydroxy-N-(pyridin-2-ylmethyl)-[1]benzothiolo[3,2-c]pyridine-3-carboxamide Traditional Name: 1-bromo-4-hydroxy-N-(2-pyridylmethyl)benzothiopheno[3,2-c]pyridine-3-carboxamide Formula: C18H12BrN3O2S MolecularWeight: 414.27578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2)C(=C(N=C3Br)C(=O)NCC4=CC=CC=N4)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2)C(=C(N=C3Br)C(=O)NCC4=CC=CC=N4)O

InChI

InChI=1S/C18H12BrN3O2S/c19-17-13-11-6-1-2-7-12(11)25-16(13)15(23)14(22-17)18(24)21-9-10-5-3-4-8-20-10/h1-8,23H,9H2,(H,21,24)